3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-N-(pyridin-3-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-N-(pyridin-3-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-5-carboxamide
3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-N-(pyridin-3-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
Compound ID: | G821-3012 |
Compound Name: | 3-[(2H-1,3-benzodioxol-5-yl)methyl]-4-oxo-N-(pyridin-3-yl)-3,4-dihydrothieno[2,3-d]pyrimidine-5-carboxamide |
Molecular Weight: | 406.42 |
Molecular Formula: | C20 H14 N4 O4 S |
Smiles: | C(c1ccc2c(c1)OCO2)N1C=Nc2c(C1=O)c(cs2)C(Nc1cccnc1)=O |
Stereo: | ACHIRAL |
logP: | 1.8843 |
logD: | 1.8841 |
logSw: | -2.6827 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.966 |
InChI Key: | YKBUKFWJTVCCRL-UHFFFAOYSA-N |